Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.35 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.32 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.32 |
| ▸ | PFKFB3 | Q16875 | 1/20 | 0.32 |
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.32 |
| ▸ | DRD4 | P21917 | 2/20 | 0.32 |
| ▸ | DRD3 | P35462 | 2/20 | 0.32 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.32 |
| ▸ | PRCP | P42785 | 1/20 | 0.32 |
| ▸ | EBP | Q15125 | 1/20 | 0.32 |
| ▸ | DRD2 | P14416 | 1/20 | 0.32 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.32 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.32 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.31 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.31 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL6934590 | 0.89 | DRD3 (0.41) | SIGMAR1DRD4DRD3NFKB1PRCP | |
| SCHEMBL6937110 | 0.88 | ESR2 (0.37) | HRH3OPRK1SIGMAR1DRD4DRD3 | |
| SCHEMBL6934203 | 0.88 | OPRK1 (0.39) | HRH3OPRK1SIGMAR1DRD4DRD3 | |
| Hydrochloric Acid SCHEMBL7874356 | 0.88 | DRD3 (0.40) | SIGMAR1DRD4DRD3NFKB1PRCP | |
| SCHEMBL6937298 | 0.87 | MAP1LC3B (0.39) | SIGMAR1DRD4DRD3NFKB1PRCP | |
| Hydrochloric Acid SCHEMBL7870761 | 0.87 | OPRK1 (0.39) | HRH3OPRD1OPRK1SIGMAR1DRD4 | |
| Hydrochloric Acid SCHEMBL7872662 | 0.87 | ESR2 (0.36) | HRH3OPRD1OPRK1SIGMAR1DRD4 | |
| Hydrochloric Acid SCHEMBL7865265 | 0.86 | MAP1LC3B (0.38) | SIGMAR1DRD4DRD3NFKB1PRCP | |
| SCHEMBL6936489 | 0.85 | PRKCZ (0.39) | HRH3OPRK1SIGMAR1DRD4DRD3 | |
| SCHEMBL6940430 | 0.84 | SLC6A2 (0.42) | HRH3SIGMAR1DRD4DRD3NFKB1 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1010689-B1 | Substituted cycloheptenes, their preparation and use | GRUENENTHAL GMBH (DE) | 2003-01-15 | — | — | EP | claimed |
| EP-1010689-A1 | Substituted cycloheptenes, their preparation and use | Grünenthal GmbH (DE) | 2000-06-21 | — | — | EP | claimed |
| EP-1010689-B1 | Substituted cycloheptenes, their preparation and use | GRUENENTHAL GMBH (DE) | 2003-01-15 | — | — | EP | disclosed |
| EP-1010689-A1 | Substituted cycloheptenes, their preparation and use | Grünenthal GmbH (DE) | 2000-06-21 | — | — | EP | disclosed |